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3,4-dimethyl-N-[(4-sulfamoylphenyl)methyl]benzamide

HCID 759574
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Basic information

CAS
6105-18-6
Standard SMILES
Cc1ccc(C(=O)NCc2ccc(S(N)(=O)=O)cc2)cc1C
InChIKey
AGOCSKKCACEIKU-UHFFFAOYSA-N
Molecular formula
C16H18N2O3S
Average molar mass
318.4 g/mol
Monoisotopic mass
318.10381361

Names & identifiers

Preferred name
3,4-dimethyl-N-[(4-sulfamoylphenyl)methyl]benzamide
IUPAC
3,4-dimethyl-N-[(4-sulfamoylphenyl)methyl]benzamide

Names & synonyms

6105-18-63,4-dimethyl-N-[(4-sulfamoylphenyl)methyl]benzamideN-[4-(aminosulfonyl)benzyl]-3,4-dimethylbenzamideCBMicro_011320Oprea1_052359DTXSID50976544SMSF0014031STK417363AKOS001615320CB14778BIM-0011513.P0013,4-dimethyl-N-(4-sulfamoylbenzyl)benzamide
Show more names
EU-0038438ST50941590AJ-292/14925199SR-01000434962SR-01000434962-1(3,4-dimethylphenyl)-N-[(4-sulfamoylphenyl)methyl]carboxamide

Database identifiers

CAS
6105-18-6
PubChem CID
759574
DTXSID
DTXSID50976544

Properties

Computed structural properties

XLogP
2
Topological polar surface area
97.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
22
Formal charge
0
Complexity
478

Related reactions

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Compound notes

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